N-(3-methylsulfanylpropyl)-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-(3-methylsulfanylpropyl)-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-(3-methylsulfanylpropyl)-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[3-(methylthio)propyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-(3-methylsulfanylpropyl)-1-propylpiperidin-1-ium-4-amine Traditional Name: 3-(methylthio)propyl-(1-propylpiperidin-1-ium-4-yl)amine Formula: C12H27N2S+ MolecularWeight: 231.42118

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NCCCSC

Isomeric SMILES

CCC[NH+]1CCC(CC1)NCCCSC

InChI

InChI=1S/C12H26N2S/c1-3-8-14-9-5-12(6-10-14)13-7-4-11-15-2/h12-13H,3-11H2,1-2H3/p+1